SCHEMBL25015396

SCHEMBL25015396

COc1cc2cc(C(=O)CCCC(=O)O)sc2cc1OC

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 19/20 0.84
ACHE P22303 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31564853 1.00 STING1 (0.84) STING1ACHE
SCHEMBL31564819 0.97 STING1 (0.84) STING1ACHE
SCHEMBL29362434 0.92 STING1 (1.00) STING1ACHE
SCHEMBL9208326 0.92 STING1 (1.00) STING1ACHE
SCHEMBL21422930 0.87 STING1 (0.85) STING1ACHE
SCHEMBL21423020 0.87 STING1 (0.85) STING1ACHE
SCHEMBL21406151 0.87 STING1 (0.85) STING1ACHE
SCHEMBL31289624 0.86 STING1 (0.71) STING1ACHE
SCHEMBL21422923 0.85 STING1 (0.87) STING1ACHE
SCHEMBL31564803 0.84 STING1 (0.64) STING1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023005267-A1 BENZO [B] SELENOPHENE STING REGULATING AGENT, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 中国药科大学 2023-02-02 WO disclosed